1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)piperazin-1-yl]propyl]-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)piperazin-1-yl]propyl]-3H-2-benzofuran-5-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)piperazin-1-yl]propyl]-3H-isobenzofuran-5-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)-1-piperazinyl]propyl]-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)piperazin-1-yl]propyl]-3H-2-benzofuran-5-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-5-yl)piperazino]propyl]phthalan-5-carbonitrile Formula: C30H29FN4O MolecularWeight: 480.575863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F)C5=CC6=C(C=C5)NC=C6

Isomeric SMILES

C1CN(CCN1CCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F)C5=CC6=C(C=C5)NC=C6

InChI

InChI=1S/C30H29FN4O/c31-26-5-3-25(4-6-26)30(28-8-2-22(20-32)18-24(28)21-36-30)11-1-13-34-14-16-35(17-15-34)27-7-9-29-23(19-27)10-12-33-29/h2-10,12,18-19,33H,1,11,13-17,21H2